Cas no 50375-08-1 (Benzene,1-chloro-3,5-diethoxy-)
50375-08-1 structure
Product Name:Benzene,1-chloro-3,5-diethoxy-
CAS No:50375-08-1
MF:C10H13ClO2
MW:200.662022352219
CID:378941
PubChem ID:3016518
Update Time:2025-04-19
Benzene,1-chloro-3,5-diethoxy- Chemical and Physical Properties
Names and Identifiers
-
- Benzene,1-chloro-3,5-diethoxy-
- 1-Chloro-3,5-diethoxybenzene
- AD976O32NP
- NS00032046
- EINECS 256-560-3
- UNII-AD976O32NP
- SCHEMBL3780893
- 50375-08-1
- DTXSID00198431
-
- Inchi： 1S/C10H13ClO2/c1-3-12-9-5-8(11)6-10(7-9)13-4-2/h5-7H,3-4H2,1-2H3
- InChI Key： IWRWBPHDNQRSIN-UHFFFAOYSA-N
- SMILES： ClC1C=C(C=C(C=1)OCC)OCC
Computed Properties
- Exact Mass: 200.06049
- Monoisotopic Mass: 200.060407
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 4
- Complexity: 127
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 3.2
- Topological Polar Surface Area: 18.5
Experimental Properties
- Density: 1.1
- Boiling Point: 273.8°C at 760 mmHg
- Flash Point: 97.2°C
- Refractive Index: 1.501
- PSA: 18.46
Benzene,1-chloro-3,5-diethoxy- Related Literature
-
Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
-
Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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